SCHEMBL3628147

SCHEMBL3628147

C=CCC(=O)CCC(=O)C=C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.40
ALDH1A1 P00352 4/20 0.40
LMNA P02545 1/20 0.30
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3627376 0.87 ALDH1A1 (0.35) TSHRALDH1A1LMNATP53HIF1A
SCHEMBL3629050 0.81 TSHR (0.56) TSHRALDH1A1LMNATP53HIF1A
SCHEMBL6427608 0.77 EGLN1 (0.47) TSHRALDH1A1LMNA
SCHEMBL175817 0.75
SCHEMBL28769030 0.75 ALDH1A1 (0.59) TSHRALDH1A1LMNA
SCHEMBL28717818 0.75 TDP1 (0.43) TSHRALDH1A1HSD17B10
SCHEMBL16653999 0.75 TSHR (0.34) TSHRHSD17B10
SCHEMBL3627630 0.75 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10
SCHEMBL101280 0.74
SCHEMBL7922575 0.74

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7695863-B2 rechargeable batteries having excellent battery cycle properties, electrical capacity and storage characteristic during charging, comprising electrodes and a nonaqueous electrolytic solution containing a dicarbonyl compound as an additive UBE INDUSTRIES, LTD. (JP) 2010-04-13 US disclosed
US-20080102377-A1 rechargeable batteries having excellent battery cycle properties, electrical capacity and storage characteristic during charging, comprising electrodes and a nonaqueous electrolytic solution containing a dicarbonyl compound as an additive UBE INDUSTRIES, LTD (JP) 2008-05-01 US disclosed